Acetylthiocholine iodide
C7H16NOS.I
1866-15-5 Copyright (C) 2023 ACS
 11  9  0  0  0  0  0  0  0  0999 V2000
    2.6675    3.8501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0012    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3337    3.0800    0.0000 N   0  3  0  0  0  4  0  0  0  0  0  0
    5.3348    3.8501    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5637    4.4137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1037    1.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6687    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0023    3.8501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6687    1.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0012    0.0000    0.0000 I   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
M  CHG  2   3   1  11  -1
M  END
> <cas.rn>
1866-15-5

> <cas.index.name>
Ethanaminium, 2-(acetylthio)-N,N,N-trimethyl-, iodide (1:1)

> <molecular.formula>
C7H16NOS.I

> <molecular.weight>
289.18

> <melting.point.experimental>
203-204 °C

$$$$
